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Information card for entry 2004965
Preview
| Coordinates | 2004965.cif |
|---|---|
| Original IUCr paper | HTML |
| Formula | C12 H8 N2 O4 S3 |
|---|---|
| Calculated formula | C12 H8 N2 O4 S3 |
| Title of publication | Bis(2-nitrophenyl) Trisulfide |
| Authors of publication | Howie, R. A.; Wardell, J. L. |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 1996 |
| Journal volume | 52 |
| Journal issue | 6 |
| Pages of publication | 1533 - 1534 |
| a | 7.839 ± 0.007 Å |
| b | 8.281 ± 0.007 Å |
| c | 13.113 ± 0.009 Å |
| α | 92.77 ± 0.06° |
| β | 104.85 ± 0.06° |
| γ | 120.82 ± 0.06° |
| Cell volume | 689.9 ± 1.1 Å3 |
| Cell temperature | 298 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for significantly intense reflections | 0.049 |
| Weighted residual factors for significantly intense reflections | 0.042 |
| Goodness-of-fit parameter for significantly intense reflections | 1.45 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
Version history
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Users of the data should acknowledge the original authors of the
structural data.